UCSF

ZINC11541293

Substance Information

In ZINC since Heavy atoms Benign functionality
February 26th, 2008 19 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.61 7.86 -13.12 1 3 0 46 294.445 2
Hi High (pH 8-9.5) 5.07 6.49 -46.47 0 3 -1 49 293.437 2

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )